(3R)-3-(1-hydroxyethyl)azetidin-2-one

C5H9NO2 — CID 68917580

IUPAC(3R)-3-(1-hydroxyethyl)azetidin-2-one
SMILESCC(O)[C@H]1CNC1=O
InChIInChI=1S/C5H9NO2/c1-3(7)4-2-6-5(4)8/h3-4,7H,2H2,1H3,(H,6,8)/t3?,4-/m1/s1
InChIKeyUMHGAVAUBIVOAL-SRBOSORUSA-N
MW115.13 g/mol
LogP-0.89
Rot. Bonds1

About (3R)-3-(1-hydroxyethyl)azetidin-2-one

(3R)-3-(1-hydroxyethyl)azetidin-2-one (PubChem CID 68917580) has the molecular formula C5H9NO2 and a molecular weight of 115.13 g/mol. Its IUPAC name is (3R)-3-(1-hydroxyethyl)azetidin-2-one.

Molecular Properties

Compound Name(3R)-3-(1-hydroxyethyl)azetidin-2-one
PubChem CID68917580
Molecular FormulaC5H9NO2
Molecular Weight115.13 g/mol
Exact Mass115.06
IUPAC Name(3R)-3-(1-hydroxyethyl)azetidin-2-one
SMILESCC(O)[C@H]1CNC1=O
InChIInChI=1S/C5H9NO2/c1-3(7)4-2-6-5(4)8/h3-4,7H,2H2,1H3,(H,6,8)/t3?,4-/m1/s1
InChIKeyUMHGAVAUBIVOAL-SRBOSORUSA-N
XLogP-0.89
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500115.13
LogP ≤ 5-0.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-(1-hydroxyethyl)pyrrolidin-2-one
CID 559138
(3S)-3-[(1S)-1-aminoethyl]azetidin-2-one
CID 54597772
(3S)-3-[(1S)-1-hydroxyethyl]-4-methylpyrrolidin-2-one
CID 55299112
4-ethyl-3-(1-hydroxyethyl)pyrrolidin-2-one
CID 85401013
(3R)-3-hydroxyazetidin-2-one
CID 97184618
3-propan-2-ylpyrrolidin-2-one;(3S)-3-propan-2-ylpyrrolidin-2-one;(3R)-3-propan-2-ylpyrrolidin-2-one
CID 158680886
(3S)-3-[(1R)-1-triphenylsilyloxyethyl]azetidin-2-one
CID 57284837
(3S,4R)-3,4-di(propan-2-yl)pyrrolidin-2-one
CID 59706724
3-[(1S)-1-hydroxyethyl]bicyclo[3.2.1]octan-2-one
CID 135038887
(2R)-2-[(1R)-1-hydroxyethyl]thiomorpholin-3-one
CID 15350235
6-propan-2-yl-3-azabicyclo[3.1.0]hexan-2-one
CID 117275039
1-(4-bromo-2,3-dihydro-1H-indol-3-yl)ethanol
CID 117199921

Frequently Asked Questions

What is the IUPAC name of (3R)-3-(1-hydroxyethyl)azetidin-2-one?
The IUPAC name of (3R)-3-(1-hydroxyethyl)azetidin-2-one (CID 68917580) is (3R)-3-(1-hydroxyethyl)azetidin-2-one.
What is the SMILES notation for (3R)-3-(1-hydroxyethyl)azetidin-2-one?
The canonical SMILES for (3R)-3-(1-hydroxyethyl)azetidin-2-one is CC(O)[C@H]1CNC1=O.
What is the InChIKey of (3R)-3-(1-hydroxyethyl)azetidin-2-one?
The InChIKey is UMHGAVAUBIVOAL-SRBOSORUSA-N. The full InChI is InChI=1S/C5H9NO2/c1-3(7)4-2-6-5(4)8/h3-4,7H,2H2,1H3,(H,6,8)/t3?,4-/m1/s1.
What are the key properties of (3R)-3-(1-hydroxyethyl)azetidin-2-one?
(3R)-3-(1-hydroxyethyl)azetidin-2-one has a molecular weight of 115.13 g/mol, XLogP of -0.89, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-3-(1-hydroxyethyl)azetidin-2-one is sourced from PubChem (CID 68917580), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).